2-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3-chloranyl-4-methyl-5-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3-chloro-4-methyl-5-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3-chloro-4-methyl-5-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H15ClN2O4S MolecularWeight: 366.8193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCC3=CC=CC=C3C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCC3=CC=CC=C3C2)Cl

InChI

InChI=1S/C16H15ClN2O4S/c1-11-15(17)8-14(9-16(11)19(20)21)24(22,23)18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9H,6-7,10H2,1H3